ChemicalBook--->CAS DataBase List--->216431-85-5

216431-85-5

216431-85-5 Structure

216431-85-5 Structure
IdentificationMore
[Name]

6-(Trifluoromethyl)nicotinonitrile
[CAS]

216431-85-5
[Synonyms]

2-TRIFLUOROMETHYL-5-CYANOPYRIDINE
5-CYANO-2-(TRIFLUOROMETHYL)PYRIDINE
6-(TRIFLUOROMETHYL)NICOTINONITRILE
6-(Trifluoromethyl)nicotinonitrile 98%
3-CYANO-6-TRIFLUOROMETHYLPYRIDINE
6-(Trifluoromethyl)nicotinonitrile98%
[EINECS(EC#)]

623-840-5
[Molecular Formula]

C7H3F3N2
[MDL Number]

MFCD03001347
[Molecular Weight]

172.11
[MOL File]

216431-85-5.mol
Chemical PropertiesBack Directory
[Melting point ]

37-41 °C(lit.)
[Boiling point ]

37-40°C 0,3mm
[density ]

1.37±0.1 g/cm3(Predicted)
[Fp ]

180 °F
[storage temp. ]

Inert atmosphere,Room Temperature
[form ]

powder to lump
[pka]

-2.89±0.22(Predicted)
[color ]

White to Light yellow
[BRN ]

8199624
[InChI]

InChI=1S/C7H3F3N2/c8-7(9,10)6-2-1-5(3-11)4-12-6/h1-2,4H
[InChIKey]

ZBLULFJVRGVQAW-UHFFFAOYSA-N
[SMILES]

C1=NC(C(F)(F)F)=CC=C1C#N
[CAS DataBase Reference]

216431-85-5(CAS DataBase Reference)
Safety DataBack Directory
[Hazard Codes ]

T+,Xi
[Risk Statements ]

R28:Very Toxic if swallowed.
R37/38:Irritating to respiratory system and skin .
R41:Risk of serious damage to eyes.
R43:May cause sensitization by skin contact.
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S28:After contact with skin, wash immediately with plenty of ... (to be specified by the manufacturer) .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
S45:In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) .
[RIDADR ]

UN 2811 6.1/PG 2
[WGK Germany ]

3
[Hazard Note ]

Irritant
[HazardClass ]

6.1
[PackingGroup ]

III
[HS Code ]

29333990
Hazard InformationBack Directory
[Uses]

6-(Trifluoromethyl)nicotinonitrile can be used as CS-1R inhibitors.
Spectrum DetailBack Directory
[Spectrum Detail]

6-(Trifluoromethyl)nicotinonitrile(216431-85-5)1HNMR
Well-known Reagent Company Product InformationBack Directory
[Alfa Aesar]

5-Cyano-2-(trifluoromethyl)pyridine, 97%(216431-85-5)
[Sigma Aldrich]

216431-85-5(sigmaaldrich)
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